Information card for entry 2208692

Structure parameters

• Chemical name: (S)-2,2'-Diethoxy-1,1'-binaphthyl
• Formula: C24 H22 O2
• Calculated formula: C24 H22 O2
• SMILES: O(c1c(c2ccccc2cc1)c1c2ccccc2ccc1OCC)CC
• Title of publication: (<i>S</i>)-2,2'-Diethoxy-1,1'-binaphthyl
• Authors of publication: Thorup, Niels; Deussen, Heinz-Josef; Bechgaard, Klaus; Bjørnholm, Thomas
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2006
• Journal volume: 62
• Journal issue: 4
• Pages of publication: o1342 - o1343
• a: 7.5637 ± 0.0005 Å
• b: 11.5604 ± 0.0007 Å
• c: 21.3353 ± 0.0013 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1865.5 ± 0.2 ų
• Cell temperature: 295 ± 2 K
• Ambient diffraction temperature: 295 ± 2 K
• Number of distinct elements: 3
• Space group number: 19
• Hermann-Mauguin space group symbol: P 21 21 21
• Hall space group symbol: P 2ac 2ab
• Residual factor for all reflections: 0.0584
• Residual factor for significantly intense reflections: 0.0393
• Weighted residual factors for significantly intense reflections: 0.0879
• Weighted residual factors for all reflections included in the refinement: 0.097
• Goodness-of-fit parameter for all reflections included in the refinement: 1.037
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes